1-Acetylpiperazine (HCID 83795)

이름 및 식별자

우선 이름: 1-Acetylpiperazine
IUPAC: 1-piperazin-1-ylethanone
영어명: 1-Acetylpiperazine
분자식: C6H12N2O
분자량: 128.17

이름 및 동의어

1-Acetylpiperazine13889-98-0EINECS 237-659-0DTXSID80160833NSC 39649RefChem:429034DTXCID1083324237-659-0N-Acetylpiperazine1-(piperazin-1-yl)ethan-1-one1-(piperazin-1-yl)ethanone1-piperazin-1-ylethanone

이름 더 보기

1-AcetyLAKOS BB-5737N-aetylpiperazineN-ACETY PIPERAZINEn-acetyl ptperazine1-Piperazinoethanone

Ethanone, 1-(1-piperazinyl)-Piperazine, 1-acetyl-MFCD00058676acetylpiperazine1-piperazin-1-yl-ethanoneA64RRE6QT5NSC-39649n-acetyl piperazine

데이터베이스 식별자

CAS: 13889-98-0
PubChem CID: 83795
DTXSID: DTXSID80160833
ChEMBL: CHEMBL2448844
ChEBI: CHEBI:194598
UNII: A64RRE6QT5
EC Number: 237-659-0
Nikkaji: J280.364J

물성

구조 계산 물성

XLogP: -0.9
극성 표면적: 32.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 9
형식 전하: 0
복잡도: 108

실험 및 물리화학적 성질

Dissociation Constants7.9

물리화학적 성질

녹는점: 31 · 31-34 °C (lit.)
끓는 점: 127 °C · 127 °C
밀도: 1.0754 · 1.0754 (rough estimate)
굴절률: 1.488 · 1.4880 (estimate)
인화점: 230 °F · >230 °F
저장 조건: Keep in dark place,Inert atmosphere,Room temperature
용해도: 1 g/10mL, · 메탄올: 가용성 1g/10mL, 투명, 무색 내지 희미한 녹황색
산도 계수 (pKa): 8.5 · 8.50±0.10(Predicted)
물리적 상태: 녹은 후에 액체
색상: 맑은 연한 노란색
수용성: 210 g/L · 물에 용해됨 210g/L(20°C).
BRN: 112220 · 112220
InChI: InChI=1S/C6H12N2O/c1-6(9)8-4-2-7-3-5-8/h7H,2-5H2,1H3
InChIKey: PKDPUENCROCRCH-UHFFFAOYSA-N
SMILES: C(=O)(N1CCNCC1)C

화학적 성질

clear light yellow liquid after melting

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (98.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (17.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 63 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (98.4%)；STOT SE 3 (17.5%)

안전 데이터

wgk: 3
HS 번호: 29339900
risk_code: 36/38-36/37/38
hazard_code: Xi
safety_code: 26-36-37/39
F 고인화성물질: 3-10-34
위험 참고 사항: Irritant
Hazard Classifications: Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야

용도1-Acetylpiperazine may be used in the synthesis of series of 7-alkoxyl substituted indolizinoquinoline-5,12-dione derivatives and 2-substituted-N-(naphth-1-ylmethyl)-pyrimidin-4-amines and 2-substituted-N-benzhydrylpyrimidin-4-amines.

일반 설명Infrared and Raman spectra of 1-acetylpiperazine have been recorded in the region of 4000-40cm-1.

상·하류 제품 정보

상류 원료

하류 제품

(4-ACETYL-PIPERAZIN-1-YL)-ACETIC ACID methyl 4-(4-acetylpiperazin-1-yl)benzoate

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

衢州润东化工有限公司0570-8789886 18892685668 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

INTATRADE GmbH+49 3493/605464 · [email protected]

연결된 노트

불러오는 중…

1-Acetylpiperazine

기본 정보